Showing 1 - 20 results of 3,278 for search '(( a ((latest decrease) OR (((largest decrease) OR (marked decrease)))) ) OR ( i large degree ))', query time: 0.84s Refine Results
  1. 1
  2. 2
  3. 3
  4. 4
  5. 5
  6. 6
  7. 7
  8. 8
  9. 9
  10. 10
  11. 11
  12. 12
  13. 13

    Large Hyperfine Coupling Arising from Pseudo‑<sup>2</sup>S Ground States in a Series of Lutetium(II) Metallocene Complexes by Danh X. Ngo (6110606)

    Published 2025
    “…Notably, these values are the largest yet observed for any lanthanide complex. Moreover, EPR and computational analysis show that the large values of <i>A</i><sub>iso</sub> stem from large s-orbital characterup to 41.2%in the corresponding singly occupied molecular orbitals. …”
  14. 14
  15. 15

    MEDOC: A Fast, Scalable, and Mathematically Exact Algorithm for the Site-Specific Prediction of the Protonation Degree in Large Disordered Proteins by Martin J. Fossat (3714079)

    Published 2025
    “…Our algorithm applies the structure of the <i>q</i>-canonical ensemble, combined with novel strategies to rapidly obtain the minimal set of parameters, thereby circumventing the combinatorial explosion of the number of charge microstates even for proteins containing a large number of ionizable amino acids. …”
  16. 16

    Development of Parallel On-the-Fly <i>Crystal</i> Algorithm for Reaction Discovery in Large and Complex Molecular Systems by Ankit Pandey (9179715)

    Published 2025
    “…This is achieved by performing an explicit exploration of a comparatively large <i>Crystal</i> configurational subspace, while gradually relaxing the remaining degrees of freedom. …”
  17. 17
  18. 18
  19. 19
  20. 20